4-(4-Chloro-3-fluorophenyl)aniline
Basic information
- CAS
863921-61-3- Standard SMILES
Nc1ccc(-c2ccc(Cl)c(F)c2)cc1- InChIKey
WKFBSNCXBGEYGG-UHFFFAOYSA-N- Molecular formula
- C12H9ClFN
- Average molar mass
- 221.66 g/mol
- Monoisotopic mass
- 221.0407551
Names & identifiers
- Preferred name
- 4-(4-Chloro-3-fluorophenyl)aniline
- IUPAC
- 4-(4-chloro-3-fluorophenyl)aniline
- English name
- 4'-Chloro-3'-fluoro-biphenyl-4-amine
- Molecular formula
- C12H9ClFN
- Molecular weight
- 221.66
Names & synonyms
863921-61-34'-Chloro-3'-fluoro-biphenyl-4-amine4-(4-chloro-3-fluorophenyl)aniline4'-Chloro-3'-fluoro-[1,1'-biphenyl]-4-amineMFCD068018664-(4-chloro-3-fluoro-phenyl)aniline4'-chloro-3'-fluoro[1,1'-biphenyl]-4-amineDTXSID801265348AKOS004114064SY279617CS-0459243F79208
Show more names
4-Amino-4’-chloro-3’-fluorobiphenyl
F778940[1,1'-Biphenyl]-4-amine, 4'-chloro-3'-fluoro-4a(2)-Chloro-3a(2)-fluoro[1,1a(2)-biphenyl]-4-amine4-Amino-4 inverted exclamation mark -chloro-3 inverted exclamation mark -fluorobiphenyl
Database identifiers
- CAS
863921-61-3- PubChem CID
- 3265089
- DTXSID
DTXSID801265348- Nikkaji
- J2.207.317F
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 204
Physicochemical properties
- storage temp.
- Store at Room Tem.
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…